3-[2-(4-chlorophenyl)-2-oxoethylidene]-7-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3,4-dihydroquinoxalin-2(1H)-one
Chemical Structure Depiction of
3-[2-(4-chlorophenyl)-2-oxoethylidene]-7-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3,4-dihydroquinoxalin-2(1H)-one
3-[2-(4-chlorophenyl)-2-oxoethylidene]-7-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3,4-dihydroquinoxalin-2(1H)-one
Compound characteristics
| Compound ID: | C301-1628 |
| Compound Name: | 3-[2-(4-chlorophenyl)-2-oxoethylidene]-7-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3,4-dihydroquinoxalin-2(1H)-one |
| Molecular Weight: | 521.4 |
| Molecular Formula: | C27 H22 Cl2 N4 O3 |
| Smiles: | C1CN(CCN1C(c1ccc2c(c1)NC(/C(=C/C(c1ccc(cc1)[Cl])=O)N2)=O)=O)c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.654 |
| logD: | 4.5168 |
| logSw: | -4.9068 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.259 |
| InChI Key: | CBVHVAINHRTDMA-UHFFFAOYSA-N |